methyl ethanoate; pyridin-1-ium; chloride

Systemtic Name: methyl ethanoate; pyridin-1-ium; chloride Openeye Name: methyl acetate; pyridin-1-ium; chloride CAS Name: acetic acid methyl ester; pyridin-1-ium; chloride IUPAC Name: methyl acetate; pyridin-1-ium; chloride Traditional Name: acetic acid methyl ester; pyridin-1-ium; chloride Formula: C8H12ClNO2 MolecularWeight: 189.63938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC.C1=CC=[NH+]C=C1.[Cl-]

Isomeric SMILES

CC(=O)OC.C1=CC=[NH+]C=C1.[Cl-]

InChI

InChI=1S/C5H5N.C3H6O2.ClH/c1-2-4-6-5-3-1;1-3(4)5-2;/h1-5H;1-2H3;1H